8,8-dimethyl-3,3-diphenyl-1,4-dioxa-8-azoniaspiro[4.5]decan-2-one iodide

Systemtic Name: 8,8-dimethyl-3,3-diphenyl-1,4-dioxa-8-azoniaspiro[4.5]decan-2-one iodide Openeye Name: 8,8-dimethyl-3,3-diphenyl-1,4-dioxa-8-azoniaspiro[4.5]decan-2-one iodide CAS Name: 8,8-dimethyl-3,3-diphenyl-1,4-dioxa-8-azoniaspiro[4.5]decan-2-one iodide IUPAC Name: 8,8-dimethyl-3,3-diphenyl-1,4-dioxa-8-azoniaspiro[4.5]decan-2-one iodide Traditional Name: 8,8-dimethyl-3,3-diphenyl-1,4-dioxa-8-azoniaspiro[4.5]decan-2-one iodide Formula: C21H24INO3 MolecularWeight: 465.32463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2(CC1)OC(=O)C(O2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[I-]

Isomeric SMILES

C[N+]1(CCC2(CC1)OC(=O)C(O2)(C3=CC=CC=C3)C4=CC=CC=C4)C.[I-]

InChI

InChI=1S/C21H24NO3.HI/c1-22(2)15-13-20(14-16-22)24-19(23)21(25-20,17-9-5-3-6-10-17)18-11-7-4-8-12-18;/h3-12H,13-16H2,1-2H3;1H/q+1;/p-1